Semiempirical QM/MM calculations reveal a step-wise proton transfer and an unusual thiolate pocket in the mechanism of the racemizing mutant G74C of arylmalonate decarboxylase

F Busch, N. Hülsemann, J Enoki, K Miyamoto, M Bocola, R Kourist*

*Corresponding author for this work

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Biochemistry, Genetics and Molecular Biology